| SpectraBase Spectrum ID |
3vuRjpBT5di |
| Name |
(4-Benzo[1,3]dioxol-5-ylmethylpiperazin-1-yl)(3,5-dimethoxyphenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.168521876 u |
| Formula |
C21H24N2O5 |
| InChI |
InChI=1S/C21H24N2O5/c1-25-17-10-16(11-18(12-17)26-2)21(24)23-7-5-22(6-8-23)13-15-3-4-19-20(9-15)28-14-27-19/h3-4,9-12H,5-8,13-14H2,1-2H3 |
| InChIKey |
GIBOJKKOCAEUEE-UHFFFAOYSA-N |
| Molecular Weight |
384.432 g/mol |
| SMILES |
C(C1=CC(OC)=CC(OC)=C1)(N1CCN(CC1)CC=1C=C2OCOC2=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834237 |
![(4-Benzo[1,3]dioxol-5-ylmethylpiperazin-1-yl)(3,5-dimethoxyphenyl)methanone](/api/spectrum/3vuRjpBT5di/structure.png?h=300&w=458 "(4-Benzo[1,3]dioxol-5-ylmethylpiperazin-1-yl)(3,5-dimethoxyphenyl)methanone")
